2-azanyl-N-(1-azanyl-1-oxidanylidene-3-phenylmethoxy-propan-2-yl)-3-[1-(1-cyclohexylcarbonylpyrrolidin-2-yl)carbonylpyrrolidin-2-yl]-3-oxidanylidene-2-[(4-phenylmethoxyphenyl)methyl]propanamide

Systemtic Name: 2-azanyl-N-(1-azanyl-1-oxidanylidene-3-phenylmethoxy-propan-2-yl)-3-[1-(1-cyclohexylcarbonylpyrrolidin-2-yl)carbonylpyrrolidin-2-yl]-3-oxidanylidene-2-[(4-phenylmethoxyphenyl)methyl]propanamide Openeye Name: 2-amino-N-[2-amino-1-(benzyloxymethyl)-2-oxo-ethyl]-2-[(4-benzyloxyphenyl)methyl]-3-[1-[1-(cyclohexanecarbonyl)pyrrolidine-2-carbonyl]pyrrolidin-2-yl]-3-oxo-propanamide CAS Name: 2-amino-N-(1-amino-1-oxo-3-phenylmethoxypropan-2-yl)-3-[1-[[1-[cyclohexyl(oxo)methyl]-2-pyrrolidinyl]-oxomethyl]-2-pyrrolidinyl]-3-oxo-2-[(4-phenylmethoxyphenyl)methyl]propanamide IUPAC Name: 2-amino-N-(1-amino-1-oxo-3-phenylmethoxypropan-2-yl)-3-[1-[1-(cyclohexanecarbonyl)pyrrolidine-2-carbonyl]pyrrolidin-2-yl]-3-oxo-2-[(4-phenylmethoxyphenyl)methyl]propanamide Traditional Name: 2-amino-N-[2-amino-1-(benzoxymethyl)-2-keto-ethyl]-2-(4-benzoxybenzyl)-3-[1-[1-(cyclohexanecarbonyl)prolyl]pyrrolidin-2-yl]-3-keto-propionamide Formula: C43H53N5O7 MolecularWeight: 751.91022

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)C(=O)N2CCCC2C(=O)N3CCCC3C(=O)C(CC4=CC=C(C=C4)OCC5=CC=CC=C5)(C(=O)NC(COCC6=CC=CC=C6)C(=O)N)N

Isomeric SMILES

C1CCC(CC1)C(=O)N2CCCC2C(=O)N3CCCC3C(=O)C(CC4=CC=C(C=C4)OCC5=CC=CC=C5)(C(=O)NC(COCC6=CC=CC=C6)C(=O)N)N

InChI

InChI=1S/C43H53N5O7/c44-39(50)35(29-54-27-31-12-4-1-5-13-31)46-42(53)43(45,26-30-20-22-34(23-21-30)55-28-32-14-6-2-7-15-32)38(49)36-18-10-24-47(36)41(52)37-19-11-25-48(37)40(51)33-16-8-3-9-17-33/h1-2,4-7,12-15,20-23,33,35-37H,3,8-11,16-19,24-29,45H2,(H2,44,50)(H,46,53)